2-oxo-N-(3-piperidin-4-yloxypropyl)-1,3-dihydroimidazole-4-carboxamide

C12H20N4O3 — CID 63870953

IUPAC2-oxo-N-(3-piperidin-4-yloxypropyl)-1,3-dihydroimidazole-4-carboxamide
SMILESO=C(NCCCOC1CCNCC1)c1c[nH]c(=O)[nH]1
InChIInChI=1S/C12H20N4O3/c17-11(10-8-15-12(18)16-10)14-4-1-7-19-9-2-5-13-6-3-9/h8-9,13H,1-7H2,(H,14,17)(H2,15,16,18)
InChIKeyVFAWVBZWVSWWST-UHFFFAOYSA-N
MW268.32 g/mol
LogP-0.41
Rot. Bonds6

About 2-oxo-N-(3-piperidin-4-yloxypropyl)-1,3-dihydroimidazole-4-carboxamide

2-oxo-N-(3-piperidin-4-yloxypropyl)-1,3-dihydroimidazole-4-carboxamide (PubChem CID 63870953) has the molecular formula C12H20N4O3 and a molecular weight of 268.32 g/mol. Its IUPAC name is 2-oxo-N-(3-piperidin-4-yloxypropyl)-1,3-dihydroimidazole-4-carboxamide.

Molecular Properties

Compound Name2-oxo-N-(3-piperidin-4-yloxypropyl)-1,3-dihydroimidazole-4-carboxamide
PubChem CID63870953
Molecular FormulaC12H20N4O3
Molecular Weight268.32 g/mol
Exact Mass268.15
IUPAC Name2-oxo-N-(3-piperidin-4-yloxypropyl)-1,3-dihydroimidazole-4-carboxamide
SMILESO=C(NCCCOC1CCNCC1)c1c[nH]c(=O)[nH]1
InChIInChI=1S/C12H20N4O3/c17-11(10-8-15-12(18)16-10)14-4-1-7-19-9-2-5-13-6-3-9/h8-9,13H,1-7H2,(H,14,17)(H2,15,16,18)
InChIKeyVFAWVBZWVSWWST-UHFFFAOYSA-N
XLogP-0.41
TPSA99.01 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 5-0.41
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-oxo-N-(3-piperidin-4-yloxypropyl)-1,3-dihydroimidazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-(3-piperidin-4-yloxypropyl)-1,3-dihydroimidazole-4-carboxamide?
The IUPAC name of 2-oxo-N-(3-piperidin-4-yloxypropyl)-1,3-dihydroimidazole-4-carboxamide (CID 63870953) is 2-oxo-N-(3-piperidin-4-yloxypropyl)-1,3-dihydroimidazole-4-carboxamide.
What is the SMILES notation for 2-oxo-N-(3-piperidin-4-yloxypropyl)-1,3-dihydroimidazole-4-carboxamide?
The canonical SMILES for 2-oxo-N-(3-piperidin-4-yloxypropyl)-1,3-dihydroimidazole-4-carboxamide is O=C(NCCCOC1CCNCC1)c1c[nH]c(=O)[nH]1.
What is the InChIKey of 2-oxo-N-(3-piperidin-4-yloxypropyl)-1,3-dihydroimidazole-4-carboxamide?
The InChIKey is VFAWVBZWVSWWST-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O3/c17-11(10-8-15-12(18)16-10)14-4-1-7-19-9-2-5-13-6-3-9/h8-9,13H,1-7H2,(H,14,17)(H2,15,16,18).
What are the key properties of 2-oxo-N-(3-piperidin-4-yloxypropyl)-1,3-dihydroimidazole-4-carboxamide?
2-oxo-N-(3-piperidin-4-yloxypropyl)-1,3-dihydroimidazole-4-carboxamide has a molecular weight of 268.32 g/mol, XLogP of -0.41, 6 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-(3-piperidin-4-yloxypropyl)-1,3-dihydroimidazole-4-carboxamide is sourced from PubChem (CID 63870953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).